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Alpha-Hydroxymetoprolol

CAT: 1299-RM-M161834-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-M161834-02Size:25 mg
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CAS Number
56392-16-6
Synonyms
1- (4- (1-hydroxy-2-methoxyethyl) phenoxy) -3- (isopropylamino) propan-2-ol
Molecular Formula
C15H25NO4
Molecular Weight
283.36
Target Alternative Name
Metoprolol
Product Name Synonym
1- (4- (1-hydroxy-2-methoxyethyl) phenoxy) -3- (isopropylamino) propan-2-ol

Chemical Information

alpha-Hydroxymetoprolol

Alpha-Hydroxymetoprolol is an aromatic ether.

CAS Number56392-16-6
PubChem CID114962
IUPAC Name1-[4-(1-hydroxy-2-methoxyethyl)phenoxy]-3-(propan-2-ylamino)propan-2-ol
Molecular FormulaC15H25NO4
Molecular Weight283.36
XLogP0.3
Topological Polar Surface Area71
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count9
Heavy Atom Count20
Formal Charge0
Complexity242
SMILES
CC(C)NCC(COC1=CC=C(C=C1)C(COC)O)O
InChI
InChI=1S/C15H25NO4/c1-11(2)16-8-13(17)9-20-14-6-4-12(5-7-14)15(18)10-19-3/h4-7,11,13,15-18H,8-10H2,1-3H3
InChIKey
OFRYBPCSEMMZHR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of alpha-Hydroxymetoprolol
CAS: 56392-16-6
CID: 114962
Formula: C15H25NO4
MW: 283.36
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight283.36
XLogP30.3
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count9
Exact Mass283.17835828
Monoisotopic Mass283.17835828
Topological Polar Surface Area71 Ų
Heavy Atom Count20
Formal Charge0
Complexity242
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
CS-O-38318Alpha-Hydroxymetoprolol-d7
HY-134670-01A-Hydroxymetoprolol
HY-134670RA-Hydroxymetoprolol (Standard)
HY-134670S1α-Hydroxymetoprolol-d7
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X749416m-Xylene-alpha,alpha,alpha,alpha',alpha',alpha'-d6
TRC-X749406-10MGo-Xylene-alpha,alpha,alpha,alpha',alpha',alpha'-d6
TRC-T793525-250MLAlpha,Alpha,Alpha-Trifluorotoluene
F4100-03PFetoprotein, Alpha (alpha Fetoprotein, Alpha, alpha-Fetoprotein, Alpha, alpha-1-Fetoprotein, Alpha, Afp, alpha-Fetoglobulin)
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